N-hydrazinylidene-5-nitropyridine-2-carboxamide

C6H5N5O3 — CID 126667337

IUPACN-hydrazinylidene-5-nitropyridine-2-carboxamide
SMILESN/N=N/C(=O)c1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C6H5N5O3/c7-10-9-6(12)5-2-1-4(3-8-5)11(13)14/h1-3H,(H2,7,9,12)
InChIKeyJVQZUNZRCQVSIW-UHFFFAOYSA-N
MW195.14 g/mol
LogP0.46
Rot. Bonds2

About N-hydrazinylidene-5-nitropyridine-2-carboxamide

N-hydrazinylidene-5-nitropyridine-2-carboxamide (PubChem CID 126667337) has the molecular formula C6H5N5O3 and a molecular weight of 195.14 g/mol. Its IUPAC name is N-hydrazinylidene-5-nitropyridine-2-carboxamide.

Molecular Properties

Compound NameN-hydrazinylidene-5-nitropyridine-2-carboxamide
PubChem CID126667337
Molecular FormulaC6H5N5O3
Molecular Weight195.14 g/mol
Exact Mass195.04
IUPAC NameN-hydrazinylidene-5-nitropyridine-2-carboxamide
SMILESN/N=N/C(=O)c1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C6H5N5O3/c7-10-9-6(12)5-2-1-4(3-8-5)11(13)14/h1-3H,(H2,7,9,12)
InChIKeyJVQZUNZRCQVSIW-UHFFFAOYSA-N
XLogP0.46
TPSA123.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.14
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-nitropyridine-2-carbothioamide
CID 82668935
5-nitro-N-propylpyridine-2-carboxamide
CID 21405282
N-methoxy-N-methyl-5-nitropyridine-2-carboxamide
CID 169122058
N-butanoyl-5-nitropyridine-2-carboxamide
CID 21405268
N-benzoyl-5-nitropyridine-2-carboxamide
CID 21405378
methane;5-nitropyridin-2-amine
CID 174857781
(Z)-2-(5-nitro-2-pyridinyl)-3-phenylprop-2-enenitrile
CID 12012670
1-[5-(4-nitrophenyl)-2-pyridinyl]ethanone
CID 86680623
2-chloro-5-nitropyridine;nitrous acid
CID 118129772
5-nitro-N-[4-(pyridin-4-ylamino)phenyl]pyridine-2-carboxamide
CID 157044268
5-nitro-N-pent-4-ynylpyridine-2-carboxamide
CID 162753441
(5-nitro-2-pyridinyl)-[(2S,6R)-2,4,6-trimethylpiperazin-1-yl]methanone
CID 97327495

Frequently Asked Questions

What is the IUPAC name of N-hydrazinylidene-5-nitropyridine-2-carboxamide?
The IUPAC name of N-hydrazinylidene-5-nitropyridine-2-carboxamide (CID 126667337) is N-hydrazinylidene-5-nitropyridine-2-carboxamide.
What is the SMILES notation for N-hydrazinylidene-5-nitropyridine-2-carboxamide?
The canonical SMILES for N-hydrazinylidene-5-nitropyridine-2-carboxamide is N/N=N/C(=O)c1ccc([N+](=O)[O-])cn1.
What is the InChIKey of N-hydrazinylidene-5-nitropyridine-2-carboxamide?
The InChIKey is JVQZUNZRCQVSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5O3/c7-10-9-6(12)5-2-1-4(3-8-5)11(13)14/h1-3H,(H2,7,9,12).
What are the key properties of N-hydrazinylidene-5-nitropyridine-2-carboxamide?
N-hydrazinylidene-5-nitropyridine-2-carboxamide has a molecular weight of 195.14 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydrazinylidene-5-nitropyridine-2-carboxamide is sourced from PubChem (CID 126667337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).